4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-methylphenyl)sulfanylethyl]butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[2-(4-methylphenyl)sulfanylethyl]butanamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)-N-[2-(p-tolylsulfanyl)ethyl]butanamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)-N-[2-[(4-methylphenyl)thio]ethyl]butanamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)-N-[2-(4-methylphenyl)sulfanylethyl]butanamide Traditional Name: 4-phthalimido-N-[2-(p-tolylthio)ethyl]butyramide Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H22N2O3S/c1-15-8-10-16(11-9-15)27-14-12-22-19(24)7-4-13-23-20(25)17-5-2-3-6-18(17)21(23)26/h2-3,5-6,8-11H,4,7,12-14H2,1H3,(H,22,24)